N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide

C20H16N6O2 — CID 59471842

IUPACN-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cnc(N)c(-c3nnc(-c4ccccc4)o3)n2)c1
InChIInChI=1S/C20H16N6O2/c1-12(27)23-15-9-5-8-14(10-15)16-11-22-18(21)17(24-16)20-26-25-19(28-20)13-6-3-2-4-7-13/h2-11H,1H3,(H2,21,22)(H,23,27)
InChIKeyMRCPPPWXZPRBTE-UHFFFAOYSA-N
MW372.39 g/mol
LogP3.40
Rot. Bonds4

About N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide

N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide (PubChem CID 59471842) has the molecular formula C20H16N6O2 and a molecular weight of 372.39 g/mol. Its IUPAC name is N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide
PubChem CID59471842
Molecular FormulaC20H16N6O2
Molecular Weight372.39 g/mol
Exact Mass372.13
IUPAC NameN-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cnc(N)c(-c3nnc(-c4ccccc4)o3)n2)c1
InChIInChI=1S/C20H16N6O2/c1-12(27)23-15-9-5-8-14(10-15)16-11-22-18(21)17(24-16)20-26-25-19(28-20)13-6-3-2-4-7-13/h2-11H,1H3,(H2,21,22)(H,23,27)
InChIKeyMRCPPPWXZPRBTE-UHFFFAOYSA-N
XLogP3.40
TPSA119.82 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.39
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide?
The IUPAC name of N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide (CID 59471842) is N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide.
What is the SMILES notation for N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide?
The canonical SMILES for N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide is CC(=O)Nc1cccc(-c2cnc(N)c(-c3nnc(-c4ccccc4)o3)n2)c1.
What is the InChIKey of N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide?
The InChIKey is MRCPPPWXZPRBTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N6O2/c1-12(27)23-15-9-5-8-14(10-15)16-11-22-18(21)17(24-16)20-26-25-19(28-20)13-6-3-2-4-7-13/h2-11H,1H3,(H2,21,22)(H,23,27).
What are the key properties of N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide?
N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide has a molecular weight of 372.39 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide is sourced from PubChem (CID 59471842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).